Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:41:35 UTC
Update Date2025-03-21 20:00:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00300193
Frequency6.6
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESCC(C=O)C(N)=O
InChI KeyWJUPBRRVUPKUKB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent 1,3-dicarbonyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • aldehyde
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,3-dicarbonyl compound